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Home > Aldehydes > 174008-48-1
174008-48-1 | 3-Pyridinecarboxaldehyde, 2-chloro-4-(trifluoromethyl)-
CAS No: 174008-48-1 Catalog No: AG001ZDK MDL No:MFCD09907846
Product Description
Catalog Number:
AG001ZDK
Chemical Name:
3-Pyridinecarboxaldehyde, 2-chloro-4-(trifluoromethyl)-
CAS Number:
174008-48-1
Molecular Formula:
C7H3ClF3NO
Molecular Weight:
209.5530
MDL Number:
MFCD09907846
IUPAC Name:
2-chloro-4-(trifluoromethyl)pyridine-3-carbaldehyde
InChI:
InChI=1S/C7H3ClF3NO/c8-6-4(3-13)5(1-2-12-6)7(9,10)11/h1-3H
InChI Key:
YXIMMXIGICNTOF-UHFFFAOYSA-N
SMILES:
O=Cc1c(Cl)nccc1C(F)(F)F
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.986g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
209.552g/mol
Monoisotopic Mass:
208.986g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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